(2R,3S)-2-heptyl-3-nitro-1-[(1S)-1-phenylethyl]pyrrolidine

Systemtic Name: (2R,3S)-2-heptyl-3-nitro-1-[(1S)-1-phenylethyl]pyrrolidine Openeye Name: (2R,3S)-2-heptyl-3-nitro-1-[(1S)-1-phenylethyl]pyrrolidine CAS Name: (2R,3S)-2-heptyl-3-nitro-1-[(1S)-1-phenylethyl]pyrrolidine IUPAC Name: (2R,3S)-2-heptyl-3-nitro-1-[(1S)-1-phenylethyl]pyrrolidine Traditional Name: (2R,3S)-2-heptyl-3-nitro-1-[(1S)-1-phenylethyl]pyrrolidine Formula: C19H30N2O2 MolecularWeight: 318.4537

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(CCN1C(C)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC[C@@H]1[C@H](CCN1[C@@H](C)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H30N2O2/c1-3-4-5-6-10-13-18-19(21(22)23)14-15-20(18)16(2)17-11-8-7-9-12-17/h7-9,11-12,16,18-19H,3-6,10,13-15H2,1-2H3/t16-,18+,19-/m0/s1